HMDB0015462 RDKit 3D Paramethasone 57 60 0 0 0 0 0 0 0 0999 V2000 2.2070 -2.6232 -0.0291 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7305 -1.3048 0.4385 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7300 -0.6144 1.4127 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7199 -0.3008 0.4056 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5501 0.3667 0.7211 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0633 0.1099 2.0667 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5412 0.1974 2.2861 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8463 -0.4717 3.4443 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.2844 -0.3996 1.0966 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1839 -1.3062 1.3116 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9553 -1.9477 0.2359 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8124 -2.8104 0.4383 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5904 -1.4483 -1.0829 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -0.5270 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9002 0.1262 -0.2171 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4060 1.5958 -0.2963 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4382 0.0338 -0.4475 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8639 0.7013 -1.6501 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9139 2.0564 -1.7126 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5807 0.2852 -1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4559 0.4588 -0.6704 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8167 1.8530 -0.3876 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7271 -0.3622 -0.7647 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7435 -1.0449 -1.9854 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9774 0.4143 -0.6598 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6223 0.6049 -1.7093 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 0.9934 0.5522 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7516 1.7090 0.2664 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0877 -3.3216 -0.1407 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7798 -2.5548 -1.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5101 -3.1010 0.6891 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7035 -1.4271 0.8944 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2021 0.1953 1.9521 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4497 -1.4249 2.1198 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4838 -1.3052 -0.0963 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3681 1.4825 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5992 0.8137 2.8206 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7224 -0.9056 2.4092 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8804 1.2451 2.3994 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3866 -1.6172 2.3492 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1083 -1.8642 -1.9651 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4695 -0.2138 -2.3407 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9721 2.2125 0.5036 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5124 1.5934 -0.0345 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 1.9841 -1.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2716 -1.0783 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4171 0.2479 -2.5349 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1314 2.5674 -0.9274 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9749 0.9126 -2.6983 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5753 -0.7948 -2.1471 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8423 2.0586 -0.8192 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1996 2.6228 -0.9046 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 2.1230 0.6816 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6887 -1.2366 -2.2322 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9619 1.6260 1.1775 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9445 0.1553 1.2271 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4842 2.6603 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 2 0 14 15 1 0 15 16 1 1 15 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 1 21 23 1 0 23 24 1 6 23 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 23 2 1 0 21 4 1 0 17 5 1 0 15 9 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 1 3 33 1 0 3 34 1 0 4 35 1 6 5 36 1 1 6 37 1 0 6 38 1 0 7 39 1 1 10 40 1 0 13 41 1 0 14 42 1 0 16 43 1 0 16 44 1 0 16 45 1 0 17 46 1 6 18 47 1 6 19 48 1 0 20 49 1 0 20 50 1 0 22 51 1 0 22 52 1 0 22 53 1 0 24 54 1 0 27 55 1 0 27 56 1 0 28 57 1 0 M END